N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)

C61H42N4Pt — CID 140933355

IUPACN-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)
SMILESCc1cnc(-c2[c-]c(N(c3[c-]c4c(cc3)c(-c3ccccc3)c(-c3ccccc3)n4-c3ccccn3)c3ccccc3-c3ccccc3)ccc2)cc1-c1ccc(-c2ccccc2)cc1.[Pt+2]
InChIInChI=1S/C61H42N4.Pt/c1-43-42-63-56(41-55(43)47-34-32-45(33-35-47)44-19-6-2-7-20-44)50-27-18-28-51(39-50)64(57-30-15-14-29-53(57)46-21-8-3-9-22-46)52-36-37-54-58(40-52)65(59-31-16-17-38-62-59)61(49-25-12-5-13-26-49)60(54)48-23-10-4-11-24-48;/h2-38,41-42H,1H3;/q-2;+2
InChIKeyXAVQCVTUWYKBGX-UHFFFAOYSA-N
MW1026.11 g/mol
LogP15.80
Rot. Bonds10

About N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)

N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+) (PubChem CID 140933355) has the molecular formula C61H42N4Pt and a molecular weight of 1026.11 g/mol. Its IUPAC name is N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+).

Molecular Properties

Compound NameN-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)
PubChem CID140933355
Molecular FormulaC61H42N4Pt
Molecular Weight1026.11 g/mol
Exact Mass1025.31
IUPAC NameN-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)
SMILESCc1cnc(-c2[c-]c(N(c3[c-]c4c(cc3)c(-c3ccccc3)c(-c3ccccc3)n4-c3ccccn3)c3ccccc3-c3ccccc3)ccc2)cc1-c1ccc(-c2ccccc2)cc1.[Pt+2]
InChIInChI=1S/C61H42N4.Pt/c1-43-42-63-56(41-55(43)47-34-32-45(33-35-47)44-19-6-2-7-20-44)50-27-18-28-51(39-50)64(57-30-15-14-29-53(57)46-21-8-3-9-22-46)52-36-37-54-58(40-52)65(59-31-16-17-38-62-59)61(49-25-12-5-13-26-49)60(54)48-23-10-4-11-24-48;/h2-38,41-42H,1H3;/q-2;+2
InChIKeyXAVQCVTUWYKBGX-UHFFFAOYSA-N
XLogP15.80
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms66
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001026.11
LogP ≤ 515.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+) with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)?
The IUPAC name of N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+) (CID 140933355) is N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+).
What is the SMILES notation for N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)?
The canonical SMILES for N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+) is Cc1cnc(-c2[c-]c(N(c3[c-]c4c(cc3)c(-c3ccccc3)c(-c3ccccc3)n4-c3ccccn3)c3ccccc3-c3ccccc3)ccc2)cc1-c1ccc(-c2ccccc2)cc1.[Pt+2].
What is the InChIKey of N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)?
The InChIKey is XAVQCVTUWYKBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H42N4.Pt/c1-43-42-63-56(41-55(43)47-34-32-45(33-35-47)44-19-6-2-7-20-44)50-27-18-28-51(39-50)64(57-30-15-14-29-53(57)46-21-8-3-9-22-46)52-36-37-54-58(40-52)65(59-31-16-17-38-62-59)61(49-25-12-5-13-26-49)60(54)48-23-10-4-11-24-48;/h2-38,41-42H,1H3;/q-2;+2.
What are the key properties of N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+)?
N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+) has a molecular weight of 1026.11 g/mol, XLogP of 15.80, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-2,3-diphenyl-N-(2-phenylphenyl)-1-pyridin-2-yl-7H-indol-7-id-6-amine;platinum(2+) is sourced from PubChem (CID 140933355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).